Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 3/20 | 0.46 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | MMP13 | P45452 | 5/20 | 0.41 |
| ▸ | MMP8 | P22894 | 4/20 | 0.41 |
| ▸ | MMP1 | P03956 | 3/20 | 0.41 |
| ▸ | MMP7 | P09237 | 1/20 | 0.41 |
| ▸ | MMP12 | P39900 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 3/20 | 0.41 |
| ▸ | MMP9 | P14780 | 3/20 | 0.41 |
| ▸ | BMP1 | P13497 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.41 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL5655796 | 0.91 | KEAP1 (0.56) | KEAP1NFE2L2MMP13MMP8MMP1 | |
| SCHEMBL7389789 | 0.86 | KEAP1 (0.44) | KEAP1NFE2L2MMP13MMP8MMP1 | |
| SCHEMBL6608765 | 0.81 | KEAP1 (0.64) | KEAP1NFE2L2MMP13MMP8MMP1 | |
| SCHEMBL6610164 | 0.79 | BMP1 (0.48) | KEAP1NFE2L2MMP13MMP8MMP1 | |
| SCHEMBL6609943 | 0.77 | MMP1 (0.47) | KEAP1NFE2L2MAPTMMP13MMP8 | |
| SCHEMBL6612548 | 0.76 | ADAM17 (0.44) | MMP13MMP8MMP1MMP7MMP2 | |
| SCHEMBL5654237 | 0.76 | MMP1 (0.69) | KEAP1NFE2L2MMP13MMP8MMP1 | |
| SCHEMBL6613444 | 0.76 | KEAP1 (0.53) | KEAP1NFE2L2KMT2AMMP13MMP8 | |
| SCHEMBL6609503 | 0.74 | BMP1 (0.52) | KEAP1NFE2L2POLBKMT2AMMP13 | |
| Anisole SCHEMBL27490678 | 0.73 | KEAP1 (0.40) | KEAP1NFE2L2MMP13MMP8MMP1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6071903-A | ENZYME INHIBITORS OF MATRIX METALLOPROTEINASES (MMPS); ANTITUMOR,-CARCINOGENIC AND -ARTHRITIC AGENTS; OSTEOARTHRITIS; RHEUMATOID DISEASES; DEGENERATIVE CARTILAGE LOSS; LONG-ACTING, ORALLY BIOAVAILABLE NONPEPTIDE INHIBITORS | AMERICAN CYANAMID COMPANY (US) | 2000-06-06 | — | — | US | disclosed |